SCHEMBL13699309

SCHEMBL13699309

Cc1ccc(S(=O)(=O)OCCOCCOCCOCCOc2cc3ncnc(Nc4cccc(Br)c4)c3cc2[N+](=O)[O-])cc1

nearest known ligand 0.67

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ FBP1 P09467 3/20 0.67
▸ EGFR P00533 17/20 0.64

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4967305 0.90 FBP1 (0.72) FBP1EGFR
SCHEMBL4968868 0.90 FBP1 (0.72) FBP1EGFR
SCHEMBL4968920 0.90 FBP1 (0.72) FBP1EGFR
SCHEMBL1417695 0.87 FBP1 (0.75) FBP1EGFR
SCHEMBL4966928 0.84 FBP1 (0.74) FBP1EGFR
SCHEMBL4968762 0.84 FBP1 (0.74) FBP1EGFR
SCHEMBL4967428 0.84 FBP1 (0.74) FBP1EGFR
SCHEMBL4968390 0.84 FBP1 (0.74) FBP1EGFR
SCHEMBL5115038 0.84 FBP1 (0.74) FBP1EGFR
SCHEMBL1418026 0.83 FBP1 (0.74) FBP1EGFR

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009113704-A2 FLUORINE-CONTAINING COMPOUND AND METHOD FOR DETECTING BIOMOLECULE USING THE SAME KYOTO UNIVERSITY (JP) 2009-09-17 — — WO disclosed
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